2-[cyclopentyl-[2-methyl-3-(methylamino)-3-phenylpropyl]amino]ethanol

C18H30N2O — CID 62618091

IUPAC2-[cyclopentyl-[2-methyl-3-(methylamino)-3-phenylpropyl]amino]ethanol
SMILESCNC(c1ccccc1)C(C)CN(CCO)C1CCCC1
InChIInChI=1S/C18H30N2O/c1-15(18(19-2)16-8-4-3-5-9-16)14-20(12-13-21)17-10-6-7-11-17/h3-5,8-9,15,17-19,21H,6-7,10-14H2,1-2H3
InChIKeyVWHVHYQUMOIQPX-UHFFFAOYSA-N
MW290.45 g/mol
LogP2.82
Rot. Bonds8

About 2-[cyclopentyl-[2-methyl-3-(methylamino)-3-phenylpropyl]amino]ethanol

2-[cyclopentyl-[2-methyl-3-(methylamino)-3-phenylpropyl]amino]ethanol (PubChem CID 62618091) has the molecular formula C18H30N2O and a molecular weight of 290.45 g/mol. Its IUPAC name is 2-[cyclopentyl-[2-methyl-3-(methylamino)-3-phenylpropyl]amino]ethanol.

Molecular Properties

Compound Name2-[cyclopentyl-[2-methyl-3-(methylamino)-3-phenylpropyl]amino]ethanol
PubChem CID62618091
Molecular FormulaC18H30N2O
Molecular Weight290.45 g/mol
Exact Mass290.24
IUPAC Name2-[cyclopentyl-[2-methyl-3-(methylamino)-3-phenylpropyl]amino]ethanol
SMILESCNC(c1ccccc1)C(C)CN(CCO)C1CCCC1
InChIInChI=1S/C18H30N2O/c1-15(18(19-2)16-8-4-3-5-9-16)14-20(12-13-21)17-10-6-7-11-17/h3-5,8-9,15,17-19,21H,6-7,10-14H2,1-2H3
InChIKeyVWHVHYQUMOIQPX-UHFFFAOYSA-N
XLogP2.82
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.45
LogP ≤ 52.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-[cyclopentyl-[2-methyl-3-(methylamino)-3-phenylpropyl]amino]ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-[cyclopentyl(2-hydroxyethyl)amino]-2-methyl-1-phenylpropan-1-ol
CID 62617126
2-[methyl-[2-methyl-3-(methylamino)-3-phenylpropyl]amino]ethanol
CID 55098990
N'-cyclopropyl-N,2-dimethyl-1-phenyl-N'-(2,2,2-trifluoroethyl)propane-1,3-diamine
CID 62618413
N'-cyclopentyl-N,N'-diethyl-2-methyl-1-phenylpropane-1,3-diamine
CID 62617718
N,N',2-trimethyl-N'-(2-methylcyclohexyl)-1-phenylpropane-1,3-diamine
CID 62618953
5-[methyl-[2-methyl-3-(methylamino)-3-phenylpropyl]amino]pentan-1-ol
CID 107204642
N,N',N',2-tetramethyl-1-phenylpropane-1,3-diamine
CID 62618717
2-methyl-3-(methylamino)-3-phenylpropan-1-ol
CID 64813233
N'-cyclopentyl-N'-ethyl-1-(2-fluorophenyl)-N,2-dimethylpropane-1,3-diamine
CID 115996757
3-[cyclohexyl(ethyl)amino]-2-methyl-1-phenylpropan-1-ol
CID 62618121
2-[cyclobutyl(2-hydroxyethyl)amino]-N-methyl-N-(1-phenylethyl)acetamide
CID 102677010
[1-[2-methyl-3-(methylamino)-3-phenylpropyl]piperidin-2-yl]methanol
CID 62617928

Frequently Asked Questions

What is the IUPAC name of 2-[cyclopentyl-[2-methyl-3-(methylamino)-3-phenylpropyl]amino]ethanol?
The IUPAC name of 2-[cyclopentyl-[2-methyl-3-(methylamino)-3-phenylpropyl]amino]ethanol (CID 62618091) is 2-[cyclopentyl-[2-methyl-3-(methylamino)-3-phenylpropyl]amino]ethanol.
What is the SMILES notation for 2-[cyclopentyl-[2-methyl-3-(methylamino)-3-phenylpropyl]amino]ethanol?
The canonical SMILES for 2-[cyclopentyl-[2-methyl-3-(methylamino)-3-phenylpropyl]amino]ethanol is CNC(c1ccccc1)C(C)CN(CCO)C1CCCC1.
What is the InChIKey of 2-[cyclopentyl-[2-methyl-3-(methylamino)-3-phenylpropyl]amino]ethanol?
The InChIKey is VWHVHYQUMOIQPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N2O/c1-15(18(19-2)16-8-4-3-5-9-16)14-20(12-13-21)17-10-6-7-11-17/h3-5,8-9,15,17-19,21H,6-7,10-14H2,1-2H3.
What are the key properties of 2-[cyclopentyl-[2-methyl-3-(methylamino)-3-phenylpropyl]amino]ethanol?
2-[cyclopentyl-[2-methyl-3-(methylamino)-3-phenylpropyl]amino]ethanol has a molecular weight of 290.45 g/mol, XLogP of 2.82, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopentyl-[2-methyl-3-(methylamino)-3-phenylpropyl]amino]ethanol is sourced from PubChem (CID 62618091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).